Compound Identification
SMILES
OC(=O)C(F)(F)F.CCC1NC2=C(N(CC3=CC=C(Br)C=C3)C1=O)C(=NC=N2)N1CCCCC1
InChIKey
InChIKey=IUAAYZXEBUDXOW-UHFFFAOYSA-N
Formula
C22H25BrF3N5O3
Mass
544.373
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pteridines and derivatives
Alternative Parents
Alpha amino acids and derivatives Dialkylarylamines Aminopyrimidines and derivatives Bromobenzenes Piperidines Aryl bromides Imidolactams Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Lactams Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organofluorides Alkyl fluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Pteridine - Dialkylarylamine - Aminopyrimidine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Piperidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Tertiary carboxylic acid amide - Lactam - Carboxamide group - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Alkyl fluoride - Carbonyl group - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alkyl halide - Organobromide - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pteridines and derivatives. These are polycyclic aromatic compounds containing a pteridine moiety, which consists of a pyrimidine fused to a pyrazine ring to form pyrimido(4,5-b)pyrazine.
External Descriptors
Not available